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1260838-10-5 | 4-Iodo-3-(2-methylbenzyl)-1H-pyrazole
CAS No: 1260838-10-5 Catalog No: AG00AI9G MDL No:
Product Description
Catalog Number:
AG00AI9G
Chemical Name:
4-Iodo-3-(2-methylbenzyl)-1H-pyrazole
CAS Number:
1260838-10-5
IUPAC Name:
4-iodo-5-[(2-methylphenyl)methyl]-1H-pyrazole
InChI:
InChI=1S/C11H11IN2/c1-8-4-2-3-5-9(8)6-11-10(12)7-13-14-11/h2-5,7H,6H2,1H3,(H,13,14)
InChI Key:
HEPRKJBWSRUJAM-UHFFFAOYSA-N
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.997g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
298.127g/mol
Monoisotopic Mass:
297.997g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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